SCHEMBL108086

SCHEMBL108086

CCCCC(CC)COC(=O)c1ccc(C(=O)O)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.73
LMNA P02545 5/20 0.73
CYP3A4 P08684 4/20 0.73
HSD17B10 Q99714 1/20 0.73
TSHR P16473 6/20 0.69
MAPK1 P28482 4/20 0.69
CA2 P00918 1/20 0.65
MAPT P10636 1/20 0.61
PRSS1 P07477 1/20 0.58
PRSS2 P07478 1/20 0.58
PRSS3 P35030 1/20 0.58
TDP1 Q9NUW8 2/20 0.53
ATM Q13315 1/20 0.53
CYP1A2 P05177 2/20 0.45
CYP2C19 P33261 2/20 0.45
ESR1 P03372 1/20 0.45
CYP2D6 P10635 1/20 0.45
NR1H2 P55055 1/20 0.45
RNASEL Q05823 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Paraben SCHEMBL11113303 0.95 ALDH1A1 (0.67) ALDH1A1LMNACYP3A4HSD17B10TSHR
Benzoic Acid SCHEMBL28570741 0.94 ALDH1A1 (0.70) ALDH1A1LMNACYP3A4HSD17B10TSHR
Benzoic Acid SCHEMBL15789975 0.94 ALDH1A1 (0.70) ALDH1A1LMNACYP3A4HSD17B10TSHR
SCHEMBL29832337 0.94 ALDH1A1 (0.81) ALDH1A1LMNACYP3A4HSD17B10TSHR
SCHEMBL29714768 0.94 ALDH1A1 (0.81) ALDH1A1LMNACYP3A4HSD17B10TSHR
SCHEMBL110764 0.94 ALDH1A1 (0.81) ALDH1A1LMNACYP3A4HSD17B10TSHR
SCHEMBL29932757 0.94 ALDH1A1 (0.81) ALDH1A1LMNACYP3A4HSD17B10TSHR
SCHEMBL30392171 0.92 ALDH1A1 (0.79) ALDH1A1LMNACYP3A4HSD17B10TSHR
Isophthalic Acid SCHEMBL28378658 0.92 ALDH1A1 (0.64) ALDH1A1LMNACYP3A4HSD17B10TSHR
SCHEMBL20924147 0.91 ALDH1A1 (0.77) ALDH1A1LMNACYP3A4HSD17B10TSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 467 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119569413-A Interface enhanced emulsified asphalt composite magnesium phosphate cement repair material and application thereof 山东大学 2025-03-07 CN claimed
CN-118291078-A Single-component low-activation aqueous polyurethane adhesive and preparation method thereof 万华化学集团股份有限公司 2024-07-05 CN claimed
CN-118269418-A Garden rubber and plastic water pipe for watering and preparation method thereof 上海沃施实业有限公司 2024-07-02 CN claimed
CN-118265597-A Additive removing device and method for removing additive using the same 株式会社LG化学 2024-06-28 CN claimed
CN-118006030-A Low-smoke halogen-free flat cable sheath and preparation method thereof 拓柔电缆(上海)有限公司 2024-05-10 CN claimed
CN-117624749-B Oil-resistant and aging-resistant rubber sealing ring and preparation method thereof 江苏冠联新材料科技股份有限公司 2024-04-05 CN claimed
CN-116057118-B Isophthalate plasticizer composition and resin composition comprising the same 株式会社LG化学 2024-03-22 CN claimed
CN-117624749-A Oil-resistant and aging-resistant rubber sealing ring and preparation method thereof 江苏冠联新材料科技股份有限公司 2024-03-01 CN claimed
WO-2023163546-A1 PLASTICIZER COMPOSITION AND RESIN COMPOSITION COMPRISING SAME 주식회사 엘지화학 2023-08-31 WO claimed
WO-2023163545-A1 PLASTICIZER COMPOSITION AND RESIN COMPOSITION COMPRISING SAME 주식회사 엘지화학 2023-08-31 WO claimed
CN-102341459-A Thermal Interface Materials and Methods for Their Preparation and Use DOW CORNING 2012-02-01 CN claimed
US-8084534-B2 Plasticised polyvinyl chloride EXXONMOBIL CHEMICAL PATENTS INC. (US) 2011-12-27 US claimed
US-20110040001-A1 Plasticised Polyvinyl Chloride EXXONMOBIL CHEMICAL PATENTS INC. 2011-02-17 US claimed
US-7875742-B2 hydrogenating organic compounds by contacting with hydrogen-containing gas in presence of catalyst which comprises catalytically active metals applied to porous catalyst support; catalytically active metals having been derived via decomposed amine complex of metal on support EXXONMOBIL CHEMICAL PATENTS INC. (US) 2011-01-25 US claimed
US-20100184895-A1 Hydrogenation Processes EXXONMOBOIL RESEARCH AND ENGINEERING COMPANY 2010-07-22 US claimed
US-7595420-B2 Hydrogenation of benzene polycarboxylic acids or derivatives thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-09-29 US claimed
US-20060247461-A1 Hydrogenation of benzene polycarboxylic acids or derivatives thereof EXXONMOBIL CHEMICAL PATENTS INC. 2006-11-02 US claimed
EP-1567470-A1 HYDROGENATION OF BENZENE POLYCARBOXYLIC ACIDS OR DERIVATIVES THEREOF ExxonMobil Chemical Patents Inc. (US) 2005-08-31 EP claimed
WO-2004046078-A1 HYDROGENATION OF BENZENE POLYCARBOXYLIC ACIDS OR DERIVATIVES THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-06-03 WO claimed
CN-1441041-A Transparent inflammable substance capable of being stably stored BI OU CHEMISTRY CO LTD (CN) 2003-09-10 CN claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100184895-A1 Hydrogenation Processes HAO2, HVCN1, AOC3 ALDH1A1 1483/4885LMNA 4345/4885CYP3A4 127/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.